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syn-4'-Cyano-5-chloro-spiro[adamantane-2,2'-octane]
SpectraBase Compound ID 4OCDJbIgayG
InChI InChI=1S/C13H16ClNO/c14-12-3-8-1-9(4-12)13(10(2-8)5-12)6-11(7-15)16-13/h8-11H,1-6H2/t8-,9-,10+,11?,12-,13+
InChIKey JJYDKXNBQUFACT-DWKHTAJTSA-N
Mol Weight 237.73 g/mol
Molecular Formula C13H16ClNO
Exact Mass 237.092042 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AHkIoMtusmC
Name syn-4'-Cyano-5-chloro-spiro[adamantane-2,2'-octane]
Alternate Name(s) anti-4'-Cyano-5-chloro-spiro[adamantane-2,2'-octane] syn-4'-Cyano-5-chloro-spiro[adamantane-2,2'-oxetane] anti-4'-Cyano-5-chloro-spiro[adamantane-2,2'-oxetane] 1-Chloro-2'-spiro[adamantane-4,4'-oxetane]carbonitrile 1-Chloranylspiro[adamantane-4,4'-oxetane]-2'-carbonitrile
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Formula C13H16ClNO
InChI InChI=1S/C13H16ClNO/c14-12-3-8-1-9(4-12)13(10(2-8)5-12)6-11(7-15)16-13/h8-11H,1-6H2/t8-,9-,10+,11?,12-,13+
InChIKey JJYDKXNBQUFACT-DWKHTAJTSA-N
Molecular Weight 237.730 g/mol
SMILES [C@]12([C@@]3(C[C@@]4(C[C@]2(C[C@@](C4)(C3)[H])[H])Cl)[H])OC(C#N)C1
SPLASH splash10-001i-2900000000-a75e669bd0c2d7a0e869
Source of Spectrum KC-0-556-5
Wiley ID 822205